# generated using pymatgen
data_Cu2H3ClO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.14297082
_cell_length_b   6.14297082
_cell_length_c   6.14297065
_cell_angle_alpha   68.52442217
_cell_angle_beta   68.52442217
_cell_angle_gamma   68.52441426
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu2H3ClO3
_chemical_formula_sum   'Cu4 H6 Cl2 O6'
_cell_volume   193.39849685
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
loop_
 _atom_site_type_symbol
 _atom_site_label
 _atom_site_symmetry_multiplicity
 _atom_site_fract_x
 _atom_site_fract_y
 _atom_site_fract_z
 _atom_site_occupancy
  Cu  Cu0  1  0.50000000  0.50000000  0.50000000  1.0
  Cu  Cu1  1  0.50000000  0.50000000  0.00000000  1.0
  Cu  Cu2  1  0.00000000  0.50000000  0.50000000  1.0
  Cu  Cu3  1  0.50000000  0.00000000  0.50000000  1.0
  H  H4  1  0.77191100  0.77191100  0.17491800  1.0
  H  H5  1  0.17491800  0.77191100  0.77191100  1.0
  H  H6  1  0.77191100  0.17491800  0.77191100  1.0
  H  H7  1  0.22808900  0.22808900  0.82508200  1.0
  H  H8  1  0.82508200  0.22808900  0.22808900  1.0
  H  H9  1  0.22808900  0.82508200  0.22808900  1.0
  Cl  Cl10  1  0.81163700  0.81163700  0.81163700  1.0
  Cl  Cl11  1  0.18836300  0.18836300  0.18836300  1.0
  O  O12  1  0.73033400  0.35559300  0.73033400  1.0
  O  O13  1  0.73033400  0.73033400  0.35559300  1.0
  O  O14  1  0.35559300  0.73033400  0.73033400  1.0
  O  O15  1  0.26966600  0.64440700  0.26966600  1.0
  O  O16  1  0.26966600  0.26966600  0.64440700  1.0
  O  O17  1  0.64440700  0.26966600  0.26966600  1.0